Cas no 377052-00-1 (Ethyl 5-(4-fluorophenyl)isoxazole-3-carboxylate)

Ethyl 5-(4-fluorophenyl)isoxazole-3-carboxylate structure
377052-00-1 structure
Product Name:Ethyl 5-(4-fluorophenyl)isoxazole-3-carboxylate
CAS No:377052-00-1
MF:C12H10FNO3
MW:235.211106777191
MDL:MFCD08446405
CID:1027827
PubChem ID:22832030
Update Time:2025-04-20

Ethyl 5-(4-fluorophenyl)isoxazole-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 5-(4-fluorophenyl)isoxazole-3-carboxylate
    • ethyl 3-(4-fluorophenyl)isoxazole-5-carboxylate
    • 5-(4-FLUOROPHENYL)-3-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER
    • 5-(4-FLUORO-PHENYL)-ISOXAZOLE-3-CARBOXYLIC ACID ETHYL ESTER
    • CS-0256662
    • SCHEMBL1686391
    • IYDBYHCVVNAFSM-UHFFFAOYSA-N
    • Ethyl 5-(4-fluorophenyl)isoxazole-3-carboxylate, AldrichCPR
    • 377052-00-1
    • DA-06319
    • SY267634
    • ethyl 5-(4-fluorophenyl)-isoxazole-3-carboxylate
    • Ethyl5-(4-fluorophenyl)isoxazole-3-carboxylate
    • ethyl 5-(4-fluorophenyl)-1,2-oxazole-3-carboxylate
    • MFCD08446405
    • F83343
    • EN300-6505106
    • 3-(4-FLUORO-PHENYL)-ISOXAZOLE-5-CARBOXYLIC ACID ETHYL ESTER
    • 640291-92-5
    • ETHYL-5-(4-FLUOROPHENYL)-ISOXAZOLE-3-CARBOXYLATE
    • MDL： MFCD08446405
    • Inchi： 1S/C12H10FNO3/c1-2-16-12(15)10-7-11(17-14-10)8-3-5-9(13)6-4-8/h3-7H,2H2,1H3
    • InChI Key： IYDBYHCVVNAFSM-UHFFFAOYSA-N
    • SMILES： FC1C=CC(=CC=1)C1=CC(C(=O)OCC)=NO1

Computed Properties

  • Exact Mass: 235.06400
  • Monoisotopic Mass: 235.06447134g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 267
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.7
  • Topological Polar Surface Area: 52.3?2

Experimental Properties

  • PSA: 52.33000
  • LogP: 2.65740

Ethyl 5-(4-fluorophenyl)isoxazole-3-carboxylate Pricemore >>

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